NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 7 S 4.4398 8.3344 116.7919 58.2364 64.6857 175.3306 8 R 3.7747 7.8589 122.2044 55.8274 29.1476 174.5277 9 H 4.1411 8.1370 109.8371 56.6772 27.5809 173.9646 10 K 4.5956 7.3391 132.4544 56.2522 33.1502 180.6602 *12 L 4.1598 8.7633 113.6678 54.6107 42.6836 174.2977 13 M 4.4410 8.6043 124.8505 54.4912 33.5995 176.5072 *14 F 4.2524 8.6102 122.9795 57.0408 38.2210 172.2201 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ 7 S 8.33 4.44 0.00 3.85 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 R 7.86 3.77 0.00 1.82 1.90 0.00 3.50 0.00 0.00 3.22 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.64 0.00 9 H 8.14 4.14 0.00 3.35 3.33 0.00 5.77 0.00 0.00 0.00 0.00 7.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 10 K 7.34 4.60 0.00 1.77 0.85 0.00 1.81 0.00 0.00 1.70 0.00 0.00 2.88 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.42 1.47 7.81 *12 L 8.76 4.16 0.00 1.60 1.63 0.92 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 13 M 8.60 4.44 0.00 2.02 1.95 0.00 0.00 0.00 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.53 0.00 *14 F 8.61 4.25 0.00 2.34 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.